Basic information
- CAS
143093-33-8- Standard SMILES
C/C(N)=C\C(=O)OC(C)C- InChIKey
YCKAGGHNUHZKCL-GQCTYLIASA-N- Molecular formula
- C7H13NO2
- Average molar mass
- 143.18 g/mol
- Monoisotopic mass
- 143.09462866
Names & identifiers
- Preferred name
- Isopropyl b-aminocrotonate
- IUPAC
- propan-2-yl (E)-3-aminobut-2-enoate
Names & synonyms
isopropyl b-aminocrotonateSCHEMBL8521397U62P976JKG(E)-Isopropyl 3-amino-2-butenoate1-Methylethyl 3-aminocrotonate, (E)-1-Methylethyl (2E)-3-amino-2-butenoate143093-33-8
Database identifiers
- CAS
143093-33-8- PubChem CID
- 5778885
- UNII
- U62P976JKG
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 150
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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